methyl 3-(3-benzamidopyridin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(3-benzamidopyridin-2-yl)sulfanylpropanoate Openeye Name: methyl 3-[(3-benzamido-2-pyridyl)sulfanyl]propanoate CAS Name: 3-[(3-benzamido-2-pyridinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(3-benzamidopyridin-2-yl)sulfanylpropanoate Traditional Name: 3-[(3-benzamido-2-pyridyl)thio]propionic acid methyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(C=CC=N1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCSC1=C(C=CC=N1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H16N2O3S/c1-21-14(19)9-11-22-16-13(8-5-10-17-16)18-15(20)12-6-3-2-4-7-12/h2-8,10H,9,11H2,1H3,(H,18,20)